3-(9H-fluoren-9-ylmethoxy)-2-[[2-(4-methylphenyl)sulfanyloxycarbonylpyrrolidin-1-yl]methyl]-3-oxidanylidene-propanoic acid

Systemtic Name: 3-(9H-fluoren-9-ylmethoxy)-2-[[2-(4-methylphenyl)sulfanyloxycarbonylpyrrolidin-1-yl]methyl]-3-oxidanylidene-propanoic acid Openeye Name: 3-(9H-fluoren-9-ylmethoxy)-3-oxo-2-[[2-(p-tolylsulfanyloxycarbonyl)pyrrolidin-1-yl]methyl]propanoic acid CAS Name: 3-(9H-fluoren-9-ylmethoxy)-2-[[2-[[(4-methylphenyl)thio]oxy-oxomethyl]-1-pyrrolidinyl]methyl]-3-oxopropanoic acid IUPAC Name: 3-(9H-fluoren-9-ylmethoxy)-2-[[2-(4-methylphenyl)sulfanyloxycarbonylpyrrolidin-1-yl]methyl]-3-oxopropanoic acid Traditional Name: 3-(9H-fluoren-9-ylmethoxy)-3-keto-2-[[2-(p-tolylthio)oxycarbonylpyrrolidino]methyl]propionic acid Formula: C30H29NO6S MolecularWeight: 531.61936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SOC(=O)C2CCCN2CC(C(=O)O)C(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

Isomeric SMILES

CC1=CC=C(C=C1)SOC(=O)C2CCCN2CC(C(=O)O)C(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

InChI

InChI=1S/C30H29NO6S/c1-19-12-14-20(15-13-19)38-37-30(35)27-11-6-16-31(27)17-25(28(32)33)29(34)36-18-26-23-9-4-2-7-21(23)22-8-3-5-10-24(22)26/h2-5,7-10,12-15,25-27H,6,11,16-18H2,1H3,(H,32,33)